Attributes
UniProt ID
Protein Name
3-hydroxyacyl- dehydratase
Ligand Name
4-chloro-2-[(5-chloroquinolin-8-yl)oxy]phenol
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
PXDPCRTVJVDTRN-UHFFFAOYSA-N
SMILES
c1cc2c(ccc(c2nc1)Oc3cc(ccc3O)Cl)Cl
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 3AZ9
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Color Legend
Unassigned regionsLigand / hetero atomse3az9A2e3az9B2e3az9C2e3az9D2e3az9E2e3az9F2e3az9G2e3az9H2e3az9I2e3az9J2e3az9K2e3az9L2e3az9M2e3az9N2e3az9O2e3az9P2e3az9Q2e3az9R2e3az9S2e3az9T2e3az9U2e3az9V2e3az9W2e3az9X2
ECOD domains from experimental PDB structures interacting with ligand K91
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q965D7 | n/a | K91 | 3az9 | e3az9C2 | C:85-228 |
| Q965D7 | n/a | K91 | 3az9 | e3az9D2 | D:84-227 |
| Q965D7 | n/a | K91 | 3az9 | e3az9E2 | E:84-228 |
| Q965D7 | n/a | K91 | 3az9 | e3az9F2 | F:84-229 |
| Q965D7 | n/a | K91 | 3az9 | e3az9M2 | M:84-229 |
| Q965D7 | n/a | K91 | 3az9 | e3az9N2 | N:85-229 |
| Q965D7 | n/a | K91 | 3az9 | e3az9O2 | O:85-228 |
| Q965D7 | n/a | K91 | 3az9 | e3az9P2 | P:84-227 |
| Q965D7 | n/a | K91 | 3az9 | e3az9Q2 | Q:84-228 |
| Q965D7 | n/a | K91 | 3az9 | e3az9R2 | R:84-229 |